In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2010 | 23 | Yes |
Popular Name: N-[[(2R)-4-isobutylmorpholin-2-yl]methyl]-1H-benzotriazole-5-carboxamide N-[[(2R)-4-isobutylmorpholin-2-y…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.44 | 1.77 | -13.19 | 2 | 7 | 0 | 83 | 317.393 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.44 | 1.71 | -42.34 | 1 | 7 | -1 | 81 | 316.385 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.44 | 3.89 | -48.4 | 3 | 7 | 1 | 84 | 318.401 | 5 | ↓ |